⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL25937946 | 0.79 | — | — | |
| Bromide SCHEMBL28720815 | 0.74 | — | — | |
| SCHEMBL27703879 | 0.74 | — | — | |
| SCHEMBL5795034 | 0.72 | — | — | |
| SCHEMBL6556863 | 0.71 | — | — | |
| SCHEMBL10607723 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL28009755 | 0.70 | GRM2 (0.34) | — | |
| Bromide SCHEMBL2260939 | 0.70 | — | — | |
| SCHEMBL27836614 | 0.69 | PTGS1 (0.36) | — | |
| SCHEMBL28018322 | 0.69 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080194854-A1 | Phosphine-substituted vinyl containing metallocene catlyst, preparation process and the application of the same | PETROCHINA COMPANY LIMITED (CN) | 2008-08-14 | — | — | US | claimed |
| WO-2024100053-A1 | COMPOSITION | MERCK PATENT GMBH (DE) | 2024-05-16 | — | — | WO | disclosed |
| EP-2943456-B1 | QUARTERNARY AMMONIUM PERFLUOROALKOXY SALTS FOR PREPARATION OF PERFLUOROPOLYETHERS | CHEMOURS CO FC LLC (US) | 2018-06-13 | — | — | EP | disclosed |
| US-7595413-B2 | Phosphine-substituted vinyl containing metallocene catalyst, preparation process and the application of the same | PETROCHINA COMPANY LIMITED (CN) | 2009-09-29 | — | — | US | disclosed |
| CN-101535179-A | Activated carbon and method for producing the same | SUMITOMO CHEMICAL CO (JP) | 2009-09-16 | — | — | CN | disclosed |
| US-20080194854-A1 | Phosphine-substituted vinyl containing metallocene catlyst, preparation process and the application of the same | PETROCHINA COMPANY LIMITED (CN) | 2008-08-14 | — | — | US | disclosed |
| CN-101184691-A | Electric double layer capacitor | SUMITOMO CHEMICAL CO (JP) | 2008-05-21 | — | — | CN | disclosed |
| CN-101180691-A | Electric double layer capacitor | SUMITOMO CHEMICAL CO (JP) | 2008-05-14 | — | — | CN | disclosed |